2,2,3-triisocyanato-3-(isocyanatomethyl)-5,5-dimethyl-cyclohexan-1-one

Systemtic Name: 2,2,3-triisocyanato-3-(isocyanatomethyl)-5,5-dimethyl-cyclohexan-1-one Openeye Name: 2,2,3-triisocyanato-3-(isocyanatomethyl)-5,5-dimethyl-cyclohexanone CAS Name: 2,2,3-triisocyanato-3-(isocyanatomethyl)-5,5-dimethyl-1-cyclohexanone IUPAC Name: 2,2,3-triisocyanato-3-(isocyanatomethyl)-5,5-dimethylcyclohexan-1-one Traditional Name: 2,2,3-triisocyanato-3-(isocyanatomethyl)-5,5-dimethyl-cyclohexanone Formula: C13H12N4O5 MolecularWeight: 304.25818

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(C1)(CN=C=O)N=C=O)(N=C=O)N=C=O)C

Isomeric SMILES

CC1(CC(=O)C(C(C1)(CN=C=O)N=C=O)(N=C=O)N=C=O)C

InChI

InChI=1S/C13H12N4O5/c1-11(2)3-10(22)13(16-8-20,17-9-21)12(4-11,15-7-19)5-14-6-18/h3-5H2,1-2H3